methyl 9-[(2-chlorophenyl)methyl]-5-oxidanyl-7-pentyl-carbazole-4-carboxylate

Systemtic Name: methyl 9-[(2-chlorophenyl)methyl]-5-oxidanyl-7-pentyl-carbazole-4-carboxylate Openeye Name: methyl 9-[(2-chlorophenyl)methyl]-5-hydroxy-7-pentyl-carbazole-4-carboxylate CAS Name: 9-[(2-chlorophenyl)methyl]-5-hydroxy-7-pentyl-4-carbazolecarboxylic acid methyl ester IUPAC Name: methyl 9-[(2-chlorophenyl)methyl]-5-hydroxy-7-pentylcarbazole-4-carboxylate Traditional Name: 7-amyl-9-(2-chlorobenzyl)-5-hydroxy-carbazole-4-carboxylic acid methyl ester Formula: C26H26ClNO3 MolecularWeight: 435.94254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)O)C3=C(C=CC=C3N2CC4=CC=CC=C4Cl)C(=O)OC

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)O)C3=C(C=CC=C3N2CC4=CC=CC=C4Cl)C(=O)OC

InChI

InChI=1S/C26H26ClNO3/c1-3-4-5-9-17-14-22-25(23(29)15-17)24-19(26(30)31-2)11-8-13-21(24)28(22)16-18-10-6-7-12-20(18)27/h6-8,10-15,29H,3-5,9,16H2,1-2H3